[3-(pyridin-4-ylamino)oxolan-3-yl]methanol

C10H14N2O2 — CID 130834966

IUPAC[3-(pyridin-4-ylamino)oxolan-3-yl]methanol
SMILESOCC1(Nc2ccncc2)CCOC1
InChIInChI=1S/C10H14N2O2/c13-7-10(3-6-14-8-10)12-9-1-4-11-5-2-9/h1-2,4-5,13H,3,6-8H2,(H,11,12)
InChIKeyHONXYOVQNMVKOE-UHFFFAOYSA-N
MW194.23 g/mol
LogP0.64
Rot. Bonds3

About [3-(pyridin-4-ylamino)oxolan-3-yl]methanol

[3-(pyridin-4-ylamino)oxolan-3-yl]methanol (PubChem CID 130834966) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is [3-(pyridin-4-ylamino)oxolan-3-yl]methanol.

Molecular Properties

Compound Name[3-(pyridin-4-ylamino)oxolan-3-yl]methanol
PubChem CID130834966
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name[3-(pyridin-4-ylamino)oxolan-3-yl]methanol
SMILESOCC1(Nc2ccncc2)CCOC1
InChIInChI=1S/C10H14N2O2/c13-7-10(3-6-14-8-10)12-9-1-4-11-5-2-9/h1-2,4-5,13H,3,6-8H2,(H,11,12)
InChIKeyHONXYOVQNMVKOE-UHFFFAOYSA-N
XLogP0.64
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-(pyridin-4-ylamino)oxolan-3-yl]methanol?
The IUPAC name of [3-(pyridin-4-ylamino)oxolan-3-yl]methanol (CID 130834966) is [3-(pyridin-4-ylamino)oxolan-3-yl]methanol.
What is the SMILES notation for [3-(pyridin-4-ylamino)oxolan-3-yl]methanol?
The canonical SMILES for [3-(pyridin-4-ylamino)oxolan-3-yl]methanol is OCC1(Nc2ccncc2)CCOC1.
What is the InChIKey of [3-(pyridin-4-ylamino)oxolan-3-yl]methanol?
The InChIKey is HONXYOVQNMVKOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c13-7-10(3-6-14-8-10)12-9-1-4-11-5-2-9/h1-2,4-5,13H,3,6-8H2,(H,11,12).
What are the key properties of [3-(pyridin-4-ylamino)oxolan-3-yl]methanol?
[3-(pyridin-4-ylamino)oxolan-3-yl]methanol has a molecular weight of 194.23 g/mol, XLogP of 0.64, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(pyridin-4-ylamino)oxolan-3-yl]methanol is sourced from PubChem (CID 130834966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).